BCYLVCZBKRSVGF-UHFFFAOYSA-N
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Catalog Number: M316096
PubChem Substance ID:363502963
Molecular Formula: C16H13ClN2O6S
Molecular Weight:396.798
Purity: ≥95%
* For research use only. Not for human or veterinary use.
Property
Molecular Formula: | C16H13ClN2O6S |
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Molecular Weight | 396.798 |
Purity | ≥95% |
Computed Descriptor
IUPAC Name | (2-chlorophenyl) 3-nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonate |
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InChI | InChI=1S/C16H13ClN2O6S/c17-12-4-1-2-5-15(12)25-26(23,24)11-7-8-13(14(10-11)19(21)22)18-9-3-6-16(18)20/h1-2,4-5,7-8,10H,3,6,9H2 |
InChIKey | BCYLVCZBKRSVGF-UHFFFAOYSA-N |
SMILES | C1CC(=O)N(C1)C2=C(C=C(C=C2)S(=O)(=O)OC3=CC=CC=C3Cl)[N+](=O)[O-] |